phenacyl (2R)-2-propyloctanoate

Systemtic Name: phenacyl (2R)-2-propyloctanoate Openeye Name: phenacyl (2R)-2-propyloctanoate CAS Name: (2R)-2-propyloctanoic acid phenacyl ester IUPAC Name: phenacyl (2R)-2-propyloctanoate Traditional Name: (2R)-2-propylcaprylic acid phenacyl ester Formula: C19H28O3 MolecularWeight: 304.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC)C(=O)OCC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCC[C@@H](CCC)C(=O)OCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C19H28O3/c1-3-5-6-8-14-17(11-4-2)19(21)22-15-18(20)16-12-9-7-10-13-16/h7,9-10,12-13,17H,3-6,8,11,14-15H2,1-2H3/t17-/m1/s1